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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H31NO3S
Molecular Weight 413.573
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(3,5-DIMETHYLPHENYL)-N-((1S,2S,3R,4R)-3-HYDROXY-4,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL)BENZENESULFONAMIDE

SMILES

CC1=CC(=CC(C)=C1)N([C@@H]2[C@H](O)[C@]3(C)CC[C@H]2C3(C)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChIKey=XOYOZKHVKVMVIE-VCHRRKICSA-N
InChI=1S/C24H31NO3S/c1-16-13-17(2)15-18(14-16)25(29(27,28)19-9-7-6-8-10-19)21-20-11-12-24(5,22(21)26)23(20,3)4/h6-10,13-15,20-22,26H,11-12H2,1-5H3/t20-,21+,22+,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H31NO3S
Molecular Weight 413.573
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:38:24 GMT 2023
Edited
by admin
on Sat Dec 16 10:38:24 GMT 2023
Record UNII
UMH468285U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(3,5-DIMETHYLPHENYL)-N-((1S,2S,3R,4R)-3-HYDROXY-4,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL)BENZENESULFONAMIDE
Systematic Name English
BENZENESULFONAMIDE, N-(3,5-DIMETHYLPHENYL)-N-(3-HYDROXY-4,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL)-, (1S-(ENDO,ENDO))-
Systematic Name English
BENZENESULFONAMIDE, N-(3,5-DIMETHYLPHENYL)-N-((1S,2S,3R,4R)-3-HYDROXY-4,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL)-
Systematic Name English
Code System Code Type Description
FDA UNII
UMH468285U
Created by admin on Sat Dec 16 10:38:24 GMT 2023 , Edited by admin on Sat Dec 16 10:38:24 GMT 2023
PRIMARY
CAS
87360-02-9
Created by admin on Sat Dec 16 10:38:24 GMT 2023 , Edited by admin on Sat Dec 16 10:38:24 GMT 2023
PRIMARY
PUBCHEM
11015169
Created by admin on Sat Dec 16 10:38:24 GMT 2023 , Edited by admin on Sat Dec 16 10:38:24 GMT 2023
PRIMARY